SCHEMBL9540633

SCHEMBL9540633

CCC(=O)N1CCC(=O)c2c1ccc(O)c2Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.39
MAPT P10636 4/20 0.39
CYP11B1 P15538 3/20 0.39
CYP11B2 P19099 3/20 0.39
TP53 P04637 2/20 0.38
PTPN11 Q06124 1/20 0.38
TSHR P16473 2/20 0.37
NOTUM Q6P988 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9537955 0.88 NOTUM (0.47) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL9539028 0.78 KDM4E (0.40) POLBMAPTTP53NOTUMKDM4E
SCHEMBL9535907 0.74 NOTUM (0.47) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL9540984 0.72 CYP11B1 (0.44) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL9537808 0.70 TP53 (0.40) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL10869086 0.70 LMNA (0.55) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL9540553 0.69 MAPT (0.47) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL9537029 0.69 CYP11B1 (0.43) POLBMAPTCYP11B1CYP11B2TP53
SCHEMBL11136938 0.69 NOTUM (0.47) POLBCYP11B1CYP11B2TP53TSHR
SCHEMBL9536870 0.68 F10 (0.41) POLBMAPTCYP11B1CYP11B2TP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0180352-B1 BENZENE-FUSED HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-26 EP disclosed
US-4767780-A SUBSTITUTED 1,4-DIHYDRO-(1)-BENZOPYRANO(4,3-C)PYRAZOLES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-30 US disclosed
US-4675324-A Substituted pyrazolo [4,3-c]pyridines and their use as uricosuric, diuretic and anti-hypertensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-23 US disclosed
EP-0180352-A2 Benzene-fused heterocyclic compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-05-07 EP disclosed